Geometry & MOs

Info

ID:	412614
PubChem CID:	135085511
Reduced:	RuP3C42H45 (1)
Stoich.:	AB3C42D45 (1)
Weight, g/mol:	335.898609
ΔH_f, kcal/mol:	185.17
Dipole, Da:	38.11
IP(EA), eV:	-5.77(-1.72)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

calcium;trifluoromethylsulfonylazanide

Drug info:

PubChemData

Smile

[CH3-].CC(C[PH+](C1=CC=CC=C1)C2=CC=CC=C2)(C[PH+](C3=CC=CC=C3)C4=CC=CC=C4)C[PH+](C5=CC=CC=C5)C6=CC=CC=C6.[Ru+]

DOS

IR

Vibrations